%chk=000288978.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288978

0 1
O 0.479395 -0.403357 1.396067
O -3.585706 1.404319 -0.113291
O -4.476678 -0.658176 0.115290
N -2.827249 -2.750010 -0.500637
C 0.319386 0.183988 -0.940064
C 0.334752 -1.180642 -1.664384
C 1.039543 1.258680 -1.785237
C -1.133434 0.660085 -0.698836
C 1.054805 -0.000338 0.406035
C -0.460849 -2.235534 -0.890066
C 2.530997 0.973546 -1.977600
C -2.155198 -0.421220 -0.492657
C 2.519679 0.283674 0.450082
C -1.861800 -1.758186 -0.601284
C 3.231200 0.745726 -0.670074
C 3.195961 0.074857 1.665240
C 4.612154 0.981113 -0.567397
C -3.492250 0.025798 -0.136930
C 4.566006 0.312439 1.763641
C 5.272953 0.764897 0.642587
C -4.864450 1.985298 0.289060
C -4.986058 1.955469 1.799494
H 1.374381 -1.529403 -1.812983
H -0.100527 -1.054543 -2.676358
H 0.916480 2.247952 -1.296967
H 0.546988 1.348917 -2.773157
H -1.472315 1.283959 -1.555251
H -1.156569 1.335731 0.187182
H 0.037972 -2.449910 0.085661
H -0.460100 -3.189327 -1.454564
H 2.997199 1.815653 -2.530897
H 2.676114 0.082763 -2.626742
H 2.626375 -0.277371 2.531734
H 5.169341 1.336412 -1.431581
H -2.555422 -3.701680 -0.330212
H -3.767379 -2.496281 -0.177989
H 5.083396 0.148947 2.706701
H 6.344593 0.951183 0.716329
H -4.767548 3.006415 -0.120567
H -5.679606 1.432873 -0.212046
H -5.854959 2.524213 2.146322
H -5.095519 0.922102 2.162693
H -4.091953 2.370570 2.281954


%chk=000288978-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288978

0 1
O 0.489685 -0.209120 1.506769
O -3.700052 1.406384 -0.123002
O -4.504414 -0.781083 0.091970
N -2.762315 -2.732748 -0.319847
C 0.348638 0.268813 -0.896694
C 0.371459 -1.119399 -1.618033
C 1.071803 1.342587 -1.761496
C -1.122993 0.723161 -0.662331
C 1.101666 0.104535 0.442136
C -0.423860 -2.186895 -0.843294
C 2.565897 1.043445 -1.996861
C -2.155446 -0.377382 -0.452939
C 2.594593 0.279800 0.445985
C -1.838854 -1.736327 -0.532257
C 3.304475 0.732317 -0.705499
C 3.301738 -0.014905 1.644489
C 4.711130 0.879713 -0.624016
C -3.520500 0.007574 -0.140574
C 4.698619 0.129598 1.709049
C 5.406854 0.580530 0.566402
C -5.060545 1.889701 0.240915
C -5.211007 2.001770 1.761788
H 1.410592 -1.471454 -1.759897
H -0.072359 -0.983292 -2.624354
H 0.968298 2.325282 -1.258681
H 0.549478 1.422670 -2.734532
H -1.433114 1.342290 -1.528808
H -1.149140 1.402899 0.209676
H 0.086424 -2.419919 0.112328
H -0.454470 -3.126806 -1.429565
H 3.047604 1.899244 -2.506457
H 2.669870 0.182737 -2.689561
H 2.720735 -0.352706 2.509156
H 5.262923 1.237989 -1.501810
H -2.495321 -3.711577 -0.389231
H -3.720613 -2.436606 -0.073701
H 5.236582 -0.099758 2.635113
H 6.495078 0.703645 0.608751
H -5.130130 2.873495 -0.252487
H -5.809401 1.196630 -0.181158
H -6.193919 2.443859 2.012234
H -5.149586 1.005433 2.230422
H -4.422005 2.645480 2.188204


